1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone

C17H18O — CID 20665286

IUPAC1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone
SMILESCCc1ccc(C(C)=O)c(-c2ccccc2C)c1
InChIInChI=1S/C17H18O/c1-4-14-9-10-16(13(3)18)17(11-14)15-8-6-5-7-12(15)2/h5-11H,4H2,1-3H3
InChIKeyVHVRDHGLTZCLFV-UHFFFAOYSA-N
MW238.33 g/mol
LogP4.43
Rot. Bonds3

About 1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone

1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone (PubChem CID 20665286) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone.

Molecular Properties

Compound Name1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone
PubChem CID20665286
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Name1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone
SMILESCCc1ccc(C(C)=O)c(-c2ccccc2C)c1
InChIInChI=1S/C17H18O/c1-4-14-9-10-16(13(3)18)17(11-14)15-8-6-5-7-12(15)2/h5-11H,4H2,1-3H3
InChIKeyVHVRDHGLTZCLFV-UHFFFAOYSA-N
XLogP4.43
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(hydroxymethyl)-2-(2-methylphenyl)benzoic acid
CID 10633904
2,4-diethyl-1-(2-methylphenyl)benzene
CID 142070386
methyl 2-(2-methylphenyl)-4-(3-oxopropyl)benzoate
CID 57234308
1-(3-ethylazulen-1-yl)ethanone
CID 15255142
1-(5-ethyl-2-propan-2-ylphenyl)ethanone
CID 117281997
1-(4-ethyl-2-phenylmethoxyphenyl)ethanone
CID 122531292
carbonic acid;1-methyl-2-(2-methylphenyl)benzene
CID 67741238
methyl 4-[3-(dibutylamino)-3-oxopropyl]-2-(2-methylphenyl)benzoate
CID 20699864
1-(2-bromo-5-ethylphenyl)ethanone
CID 83988474
9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene
CID 143561149
1-[2-(2,3-dimethylphenyl)-4-fluorophenyl]ethanone
CID 114068433
methyl 4-[[(2S)-1-cyclohexyl-3-hydroxypropan-2-yl]oxymethyl]-2-(2-methylphenyl)benzoate
CID 59949039

Frequently Asked Questions

What is the IUPAC name of 1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone?
The IUPAC name of 1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone (CID 20665286) is 1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone.
What is the SMILES notation for 1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone?
The canonical SMILES for 1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone is CCc1ccc(C(C)=O)c(-c2ccccc2C)c1.
What is the InChIKey of 1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone?
The InChIKey is VHVRDHGLTZCLFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O/c1-4-14-9-10-16(13(3)18)17(11-14)15-8-6-5-7-12(15)2/h5-11H,4H2,1-3H3.
What are the key properties of 1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone?
1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone has a molecular weight of 238.33 g/mol, XLogP of 4.43, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-ethyl-2-(2-methylphenyl)phenyl]ethanone is sourced from PubChem (CID 20665286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).